trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane

C18H34OSi — CID 5365996

IUPACtrimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CO[Si](C)(C)C
InChIInChI=1S/C18H34OSi/c1-16(2)10-8-11-17(3)12-9-13-18(4)14-15-19-20(5,6)7/h10,12,14H,8-9,11,13,15H2,1-7H3/b17-12+,18-14+
InChIKeyWMPDMQCCFFSRIM-NXGXIAAHSA-N
MW294.56 g/mol
LogP6.26
Rot. Bonds9

About trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane

trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane (PubChem CID 5365996) has the molecular formula C18H34OSi and a molecular weight of 294.56 g/mol. Its IUPAC name is trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane.

Molecular Properties

Compound Nametrimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane
PubChem CID5365996
Molecular FormulaC18H34OSi
Molecular Weight294.56 g/mol
Exact Mass294.24
IUPAC Nametrimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CO[Si](C)(C)C
InChIInChI=1S/C18H34OSi/c1-16(2)10-8-11-17(3)12-9-13-18(4)14-15-19-20(5,6)7/h10,12,14H,8-9,11,13,15H2,1-7H3/b17-12+,18-14+
InChIKeyWMPDMQCCFFSRIM-NXGXIAAHSA-N
XLogP6.26
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.56
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Silicic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ethyl ester
CID 138395831
Geraniol, tert-butyldimethylsilyl ether
CID 6536899
Geraniol, TMS derivative
CID 10998725
Nerol, trimethylsilyl ether
CID 11817006
cis-2-Hexen-1-ol, tert-butyldimethylsilyl ether
CID 91697283
Farnesol, tert-butyldimethylsilyl ether
CID 10337114
Silane, dimethyldi(trans-3,7-dimethyl-2,6-octadien-1-yloxy)-
CID 19045075
tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane
CID 10987644
Ctk0J4668
CID 11106001
[(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane
CID 11543224
[(2E)-3,7-dimethylocta-2,6-dienyl]-triethoxysilane
CID 88814215
6-[(E)-but-2-en-2-yl]-2,2,5-trimethyl-3,6-dihydrooxasiline
CID 135063549

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane?
The IUPAC name of trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane (CID 5365996) is trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane.
What is the SMILES notation for trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane?
The canonical SMILES for trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane is CC(C)=CCC/C(C)=C/CC/C(C)=C/CO[Si](C)(C)C.
What is the InChIKey of trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane?
The InChIKey is WMPDMQCCFFSRIM-NXGXIAAHSA-N. The full InChI is InChI=1S/C18H34OSi/c1-16(2)10-8-11-17(3)12-9-13-18(4)14-15-19-20(5,6)7/h10,12,14H,8-9,11,13,15H2,1-7H3/b17-12+,18-14+.
What are the key properties of trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane?
trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane has a molecular weight of 294.56 g/mol, XLogP of 6.26, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]silane is sourced from PubChem (CID 5365996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).